1-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]-3-(2-nitrophenyl)thiourea

Systemtic Name: 1-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]-3-(2-nitrophenyl)thiourea Openeye Name: 1-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]-3-(2-nitrophenyl)thiourea CAS Name: 1-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]-3-(2-nitrophenyl)thiourea IUPAC Name: 1-[(Z)-1-(4-methylsulfonylphenyl)ethylideneamino]-3-(2-nitrophenyl)thiourea Traditional Name: 1-[(Z)-1-(4-mesylphenyl)ethylideneamino]-3-(2-nitrophenyl)thiourea Formula: C16H16N4O4S2 MolecularWeight: 392.45264

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC1=CC=CC=C1[N+](=O)[O-])C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

C/C(=N/NC(=S)NC1=CC=CC=C1[N+](=O)[O-])/C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C16H16N4O4S2/c1-11(12-7-9-13(10-8-12)26(2,23)24)18-19-16(25)17-14-5-3-4-6-15(14)20(21)22/h3-10H,1-2H3,(H2,17,19,25)/b18-11-